Chemical Properties of Phthalic acid, 2-(3-bromophenyl)ethyl ethyl ester

Phthalic acid, 2-(3-bromophenyl)ethyl ethyl ester

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InChI
InChI=1S/C18H17BrO4/c1-2-22-17(20)15-8-3-4-9-16(15)18(21)23-11-10-13-6-5-7-14(19)12-13/h3-9,12H,2,10-11H2,1H3
InChI Key
HDVASJDLQFWOAC-UHFFFAOYSA-N
Formula
C18H17BrO4
SMILES
CCOC(=O)c1ccccc1C(=O)OCCc1cccc(Br)c1
Molecular Weight1
377.23
Sources

Physical Properties

Property Value Unit Source
Δf -147.28 kJ/mol Joback Calculated Property
Δfgas -428.00 kJ/mol Joback Calculated Property
Δfus 40.54 kJ/mol Joback Calculated Property
Δvap 86.28 kJ/mol Joback Calculated Property
logPoct/wat 4.03 Crippen Calculated Property
Pc 2157.31 kPa Joback Calculated Property
Tboil 893.30 K Joback Calculated Property
Tc 1131.83 K Joback Calculated Property
Tfus 574.62 K Joback Calculated Property
Vc 0.94 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 699.78 J/mol×K 893.3 Joback Calculated Property
η 0.00 Pa×s 893.3 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 8
=C< (ring) 4
-CH2- 3
-CH3 1
-Br 1

Similar Compounds

Phthalic acid, 2-(3-bromophenyl)ethyl propyl ester. Phthalic acid, 2-(3-bromophenyl)ethyl isobutyl ester. Phthalic acid, 2-(3-bromophenyl)ethyl butyl ester. Phthalic acid, 2-(3-bromophenyl)ethyl pentyl ester. Phthalic acid, 2-(4-bromophenyl)ethyl ethyl ester. Phthalic acid, 2-(3-bromophenyl)ethyl hexyl ester. Phthalic acid, 2-(3-bromophenyl)ethyl heptyl ester. Phthalic acid, 2-(3-bromophenyl)ethyl undecyl ester. Phthalic acid, 2-(3-bromophenyl)ethyl octyl ester. Phthalic acid, 2-(3-bromophenyl)ethyl nonyl ester. Phthalic acid, 2-(3-bromophenyl)ethyl dodecyl ester. Phthalic acid, 2-(3-bromophenyl)ethyl decyl ester. Phthalic acid, 2-(4-bromophenyl)ethyl propyl ester. Phthalic acid, 2-(2-bromophenyl)ethyl ethyl ester. Phthalic acid, 2-(4-bromophenyl)ethyl isobutyl ester.

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